Vitas-M small molecule compound

5-(6-chloro-2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-6-hydroxy-2,2-dimethyl-4H-1,3-dioxin-4-one

Catalog ID
STK607299
SMILES Clc1ccc2c(c1)c1CCNC(c1[nH]2)C1=C(O)OC(OC1=O)(C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C17H17ClN2O4 MW 348.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN2O4/c1-17(2)23-15(21)12(16(22)24-17)14-13-9(5-6-19-14)10-7-8(18)3-4-11(10)20-13/h3-4,7,14,19-21H,5-6H2,1-2H3
InChIKey
YCURTRQAAQWCBK-UHFFFAOYSA-N
Synonyms

5(6chloro2349tetrahydro1Hbetacarbolin1yl)6hydroxy22dimethyl4H13dioxin4one
5(6chloro2349tetrahydro1Hpyrido(34b)indol1yl)6hydroxy22dimethyl13dioxin4one
5(6chloro2349tetrahydro1Hpyrido(34b)indol1yl)6hydroxy22dimethyl4H13dioxin4one
CC1(OC(=C(C(=O)O1)C2C3=C(CCN2)C4=C(N3)C=CC(=C4)Cl)O)C
Clc1ccc2c(c1)c1CCNC(c1(nH)2)C1=C(O)OC(OC1=O)(C)C
InChI=1SC17H17ClN2O4c117(2)2315(21)12(16(22)2417)14139(561914)1078(18)3411(10)2013h347141921H56H212H3
MFCD08746553
ZINC000013626574
ZINC000013626577

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Available files

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